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Home > Boronic Acids > 832114-00-8
832114-00-8 | 3,5-Dimethylisoxazole-4-Boronic Acid Pinacol Ester
CAS No: 832114-00-8 Catalog No: AG0033JL MDL No:MFCD05863910
Product Description
Catalog Number:
AG0033JL
Chemical Name:
3,5-Dimethylisoxazole-4-Boronic Acid Pinacol Ester
CAS Number:
832114-00-8
Molecular Formula:
C11H18BNO3
Molecular Weight:
223.0765
MDL Number:
MFCD05863910
IUPAC Name:
3,5-dimethyl-4-(4,4,5,5-tetramethyl-1,3,2-dioxaborolan-2-yl)-1,2-oxazole
InChI:
InChI=1S/C11H18BNO3/c1-7-9(8(2)14-13-7)12-15-10(3,4)11(5,6)16-12/h1-6H3
InChI Key:
CVLHETBAROWASE-UHFFFAOYSA-N
SMILES:
Cc1onc(c1B1OC(C(O1)(C)C)(C)C)C
Properties
Complexity:
266
Compound Is Canonicalized:
Yes
Covalently-Bonded Unit Count:
1
Defined Atom Stereocenter Count:
0
Defined Bond Stereocenter Count:
0
Exact Mass:
223.138g/mol
Formal Charge:
0
Heavy Atom Count:
16
Hydrogen Bond Acceptor Count:
4
Hydrogen Bond Donor Count:
0
Isotope Atom Count:
0
Molecular Weight:
223.079g/mol
Monoisotopic Mass:
223.138g/mol
Rotatable Bond Count:
1
Topological Polar Surface Area:
44.5A^2
Undefined Atom Stereocenter Count:
0
Undefined Bond Stereocenter Count:
0
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